General Information of the Compound
| Compound ID |
CP0393703
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| Compound Name |
4-[5-(acetyloxyamino)-2-carboxy-5-oxopentyl]benzoic acid
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| Structure |
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| Formula |
C15H17NO7
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| Molecular Weight |
323.301
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| Canonical SMILES |
CC(=O)ONC(=O)CCC(Cc1ccc(cc1)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C15H17NO7/c1-9(17)23-16-13(18)7-6-12(15(21)22)8-10-2-4-11(5-3-10)14(19)20/h2-5,12H,6-8H2,1H3,(H,16,18)(H,19,20)(H,21,22)
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| InChIKey |
OCUVCELAYRKOBB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound